This years CUP event was held March 6-8, 2018 at the Inn and Spa at Loretto in Santa Fe, NM.
CUP Agenda:
Monday, March 5
Orion Partners Programming Day
Tuesday, March 6
Morning Session:
- 9:00 - Opening Remarks - Anthony Nicholls, CEO, OpenEye
- 9:20 - Orion Demo - Anthony Nicholls, Orion Product Manager, OpenEye
- 10:00 - Break
- 10:30 - Science Projects
- 11:30 - The Open Force Field Initiative - Christopher Bayly
- 12:00 - Lunch
Afternoon Session:
- 2:00 - Toolkit Updates - Krisztina Boda
- 2:25 - Product Updates - Paul Hawkins
- 2:50 - Orion Modeling Services - Jeff Grandy, VP Sales, OpenEye
- 3:15 - Break
- 3:45 - Project Reports
- 5:00 - End of Session
- 5:15 -Frank K. Brown Address: Industry Perspective - Juan Alvarez, Executive Director, Head of Modeling and Informatics, Merck
- 6:30 - Reception
Wednesday, March 7
Morning Session: Machine Learning
Afternoon Session: Machine Learning
- 2:00 - “Automating Automated Drug Discovery” - Adrian Schreyer, ExScientia
- 2:30 -“Machine Learning: the hero [pharma] deserves, but not the one it needs?” - Steven Kearnes, Google
- 3:00 - “Boosting Drug Discovery with Machine Learning” - Rishi Gupta, Abbvie
- 3:30 - Break
- 4:00 - The Levinthal Lecture, “Health insurance and prediction. Who knew it was complicated?” - Kim Branson, Chief Data Scientist, Lumiata Inc., Chief Technology Officer, Lifespan AI
6:00 - Poster Session
Thursday, March 8
Morning Session: Practical Molecular Dynamics
Afternoon Session: Automation and Large-scale